(3-ethyl-2-methyloxolan-3-yl)methanamine

C8H17NO — CID 114533945

IUPAC(3-ethyl-2-methyloxolan-3-yl)methanamine
SMILESCCC1(CN)CCOC1C
InChIInChI=1S/C8H17NO/c1-3-8(6-9)4-5-10-7(8)2/h7H,3-6,9H2,1-2H3
InChIKeyCIBOKCLQHQKXFS-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.15
Rot. Bonds2

About (3-ethyl-2-methyloxolan-3-yl)methanamine

(3-ethyl-2-methyloxolan-3-yl)methanamine (PubChem CID 114533945) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (3-ethyl-2-methyloxolan-3-yl)methanamine.

Molecular Properties

Compound Name(3-ethyl-2-methyloxolan-3-yl)methanamine
PubChem CID114533945
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(3-ethyl-2-methyloxolan-3-yl)methanamine
SMILESCCC1(CN)CCOC1C
InChIInChI=1S/C8H17NO/c1-3-8(6-9)4-5-10-7(8)2/h7H,3-6,9H2,1-2H3
InChIKeyCIBOKCLQHQKXFS-UHFFFAOYSA-N
XLogP1.15
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(bromomethyl)-3-ethyl-2-methyloxolane
CID 114535961
[3-(2-ethylsulfonylethyl)-2-methyloxolan-3-yl]methanamine
CID 114534101
1-(3-ethyl-2-methyloxolan-3-yl)-N-methylmethanamine
CID 114534117
[3-(hydroxymethyl)-2-methyloxolan-3-yl]methanol
CID 130490555
[2-methyl-3-[(1-methylpyrazol-4-yl)methyl]oxolan-3-yl]methanamine
CID 114534040
[3-[2-(4-bromophenoxy)ethyl]-2-methyloxolan-3-yl]methanamine
CID 114533972
[2-methyl-3-(2-propan-2-ylsulfonylethyl)oxolan-3-yl]methanamine
CID 106730398
[3-(furan-3-ylmethyl)-2-methyloxolan-3-yl]methanamine
CID 114534069
[3-[3-(2-methoxyethoxy)propyl]-2-methyloxolan-3-yl]methanamine
CID 103412747
[2-methyl-3-(thiophen-3-ylmethyl)oxolan-3-yl]methanamine
CID 114534046
[2-methyl-3-[(2-methyltetrazol-5-yl)methyl]oxolan-3-yl]methanamine
CID 107053595
3-(aminomethyl)-2-methyl-N-propyloxolan-3-amine
CID 82718753

Frequently Asked Questions

What is the IUPAC name of (3-ethyl-2-methyloxolan-3-yl)methanamine?
The IUPAC name of (3-ethyl-2-methyloxolan-3-yl)methanamine (CID 114533945) is (3-ethyl-2-methyloxolan-3-yl)methanamine.
What is the SMILES notation for (3-ethyl-2-methyloxolan-3-yl)methanamine?
The canonical SMILES for (3-ethyl-2-methyloxolan-3-yl)methanamine is CCC1(CN)CCOC1C.
What is the InChIKey of (3-ethyl-2-methyloxolan-3-yl)methanamine?
The InChIKey is CIBOKCLQHQKXFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-3-8(6-9)4-5-10-7(8)2/h7H,3-6,9H2,1-2H3.
What are the key properties of (3-ethyl-2-methyloxolan-3-yl)methanamine?
(3-ethyl-2-methyloxolan-3-yl)methanamine has a molecular weight of 143.23 g/mol, XLogP of 1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethyl-2-methyloxolan-3-yl)methanamine is sourced from PubChem (CID 114533945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).